SCHEMBL20149211

SCHEMBL20149211

CCc1ccccc1-c1c(-c2ccccc2C)nnn1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 5/20 0.46
▸ TDO2 P48775 5/20 0.46
▸ KCNN4 O15554 1/20 0.38
▸ ADORA2A P29274 1/20 0.36
▸ DHFR P00374 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ DPP4 P27487 1/20 0.35
▸ TP53 P04637 2/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ HEXA P06865 1/20 0.35
▸ HEXB P07686 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK1 P23458 1/20 0.34
▸ TYK2 P29597 1/20 0.34
▸ JAK3 P52333 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27489118 0.79 DPP4 (0.41) IDO1TDO2ADORA2ASMN1; SMN2DPP4
SCHEMBL27507080 0.75 DCTPP1 (0.43) IDO1TDO2KCNN4ADORA2ASMN1; SMN2
SCHEMBL24833974 0.72 NSD2 (0.46) IDO1TDO2SMN1; SMN2DPP4CYP2D6
SCHEMBL5599467 0.70 CSNK2A2 (0.49) IDO1KCNN4DHFRSMN1; SMN2CYP2D6
SCHEMBL23422767 0.67 TDO2 (0.46) IDO1TDO2SMN1; SMN2CYP2D6MAPT
SCHEMBL1132663 0.67 MYC (0.50) DHFRCYP2D6HEXAHEXBMAPK1
SCHEMBL22134296 0.66 ALDH1A1 (0.42) CYP2D6MAPT
SCHEMBL12324828 0.66 IDO1 (0.42) IDO1TDO2KCNN4SMN1; SMN2DPP4
SCHEMBL14551981 0.66 IDO1 (0.42) IDO1TDO2KCNN4SMN1; SMN2DPP4
SCHEMBL25015339 0.66 TTR (0.46) MAPTHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018089373-A9 STEROIDS AND PROTEIN-CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2018-07-12 — — WO disclosed
WO-2018089373-A2 STEROIDS AND PROTEIN-CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2018-05-17 — — WO disclosed
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